Compound Identification
SMILES
CN1C=CC(NC2=NC(OC3CCC(CC3)N3CCOCC3)=C3C(SC4=CC=CC=C34)=N2)=N1
InChIKey
InChIKey=CIIRTNTVSQVXMC-UHFFFAOYSA-N
Formula
C24H28N6O2S
Mass
464.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thienopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thienopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thienopyrimidines
Alternative Parents
1-benzothiophenes Cyclohexylamines Aminopyrimidines and derivatives Alkyl aryl ethers Morpholines Imidolactams Benzenoids Thiophenes Pyrazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - Benzothiophene - Thienopyrimidine - Alkyl aryl ether - Aminopyrimidine - Cyclohexylamine - Morpholine - Oxazinane - Imidolactam - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - Thiophene - Pyrazole - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Dialkyl ether - Ether - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available